4-[2-[(E)-1-cyano-2-methylsulfanyl-2-phenylazanyl-ethenyl]-1,3-thiazol-4-yl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[2-[(E)-1-cyano-2-methylsulfanyl-2-phenylazanyl-ethenyl]-1,3-thiazol-4-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[2-[(E)-2-anilino-1-cyano-2-methylsulfanyl-vinyl]thiazol-4-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[2-[(E)-2-anilino-1-cyano-2-(methylthio)ethenyl]-4-thiazolyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[2-[(E)-2-anilino-1-cyano-2-methylsulfanylethenyl]-1,3-thiazol-4-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[2-[(E)-2-anilino-1-cyano-2-(methylthio)vinyl]thiazol-4-yl]-N,N-dimethyl-benzenesulfonamide Formula: C21H20N4O2S3 MolecularWeight: 456.6041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)C(=C(NC3=CC=CC=C3)SC)C#N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=N2)/C(=C(\NC3=CC=CC=C3)/SC)/C#N

InChI

InChI=1S/C21H20N4O2S3/c1-25(2)30(26,27)17-11-9-15(10-12-17)19-14-29-21(24-19)18(13-22)20(28-3)23-16-7-5-4-6-8-16/h4-12,14,23H,1-3H3/b20-18+